UCSF

ZINC16661507

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2008 31 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.40 -0.22 -29.97 2 12 0 165 472.501 7
Hi High (pH 8-9.5) 0.40 -0.64 -67.45 1 12 -1 167 471.493 7

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )